ethyl 1-(2-chloranyl-3-phenoxy-propyl)-4-pyrrolidin-1-yl-pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: ethyl 1-(2-chloranyl-3-phenoxy-propyl)-4-pyrrolidin-1-yl-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 1-(2-chloro-3-phenoxy-propyl)-4-pyrrolidin-1-yl-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-(2-chloro-3-phenoxypropyl)-4-(1-pyrrolidinyl)-5-pyrazolo[3,4-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-chloro-3-phenoxypropyl)-4-pyrrolidin-1-ylpyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-(2-chloro-3-phenoxy-propyl)-4-pyrrolidino-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C22H25ClN4O3 MolecularWeight: 428.9119

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C1N3CCCC3)C=NN2CC(COC4=CC=CC=C4)Cl

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C1N3CCCC3)C=NN2CC(COC4=CC=CC=C4)Cl

InChI

InChI=1S/C22H25ClN4O3/c1-2-29-22(28)19-12-24-21-18(20(19)26-10-6-7-11-26)13-25-27(21)14-16(23)15-30-17-8-4-3-5-9-17/h3-5,8-9,12-13,16H,2,6-7,10-11,14-15H2,1H3